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Calculation of One- and Two-Photon Absorption Spectra of Thiolated Gold Nanoclusters using Time-Dependent Density Functional Theory

Paul N. Day、Kiet A. Nguyen、Ruth Pachter2010-08-09Journal of Chemical Theory and Computation

The one- (OPA) and two-photon (TPA) absorption spectra have been calculated for a gold dimer, for a monothiolated gold dimer anion, for a thiolated gold cluster [Au25(SH)18](-1), whose structure has been determined, and for a proposed cluster [Au12(SR)9](+1) using time-dependent density functional theory (TDDFT). Geom…

Gold and Silver Nanoparticles Synthesis and ApplicationsNanocluster Synthesis and ApplicationsAdvanced Nanomaterials in Catalysis

Large inverse magnetic entropy changes and magnetoresistance in the vicinity of a field-induced martensitic transformation in Ni50−xCoxMn32−yFeyGa18

Arjun K. Pathak、Igor Dubenko、H.E. Karaca 等 5 位作者2010-08-09Applied Physics Letters

Significantly large inverse magnetic entropy changes (ΔSM) and magnetoresistance (MR) were observed at the inverse martensitic phase transitions of the Ga-based magnetic shape memory Heusler alloys: Ni50−xCoxMn32−yFeyGa18. The crystal structures of alloys were tetragonal at 300 K and the phase transition temperatures…

Magnetic and transport properties of perovskites and related materialsShape Memory Alloy TransformationsCreativity in Education and Neuroscience

Synthesis of Self-assembling Cyclic Peptide-polymer Conjugates using Click Chemistry

Robert Chapman、Katrina A. Jolliffe、Sébastien Perrier2010-08-09Australian Journal of Chemistry

Self-assembling cyclic peptide-polymer conjugates were prepared by ‘clicking’ polymers (prepared by RAFT polymerization) to an azide functionalized d-alt-l cyclic octapeptide via the Huisgen 1,3-dipolar cycloaddition reaction. Due to the high graft density, the efficiency of the click chemistry conjugation reaction wa…

Chemical Synthesis and AnalysisSupramolecular Self-Assembly in MaterialsClick Chemistry and Applications

Bilayer membranes in micro-fluidics: from gel emulsions to soft functional devices

Shashi Thutupalli、Stephan Herminghaus、Ralf Seemann2010-08-09Soft Matter

We outline a concept of self-assembled soft matter devices based on micro-fluidics, which use surfactant bilayer membranes as their main building blocks, arrested in geometric structures provided by top-down lithography. Membranes form spontaneously when suitable water-in-oil emulsions are forced into micro-fluidic ch…

Lipid Membrane Structure and BehaviorSupramolecular Self-Assembly in MaterialsPickering emulsions and particle stabilization

Photoassisted Degradation of 4-Chlorophenol and p-Cresol Using MgAl Hydrotalcites

A. Mantilla、Gabriela Jácome‐Acatitla、Getsemaní Morales-Mendoza 等 5 位作者2010-08-09Industrial & Engineering Chemistry Research

MgAl hydrotalcites, or layered double hydroxides (LDHs), with different Mg/Al molar ratios were synthesized by the coprecipitation method. The structure of the solids was collapsed by thermal treatment at 723 K obtaining MgAl mixed oxides with high specific surface areas (264−318 m 2 /g). When these oxides were put in…

Advanced Photocatalysis TechniquesLayered Double Hydroxides Synthesis and ApplicationsMagnesium Oxide Properties and Applications

Invisible cloaking of material bodies using the wave flow method

А. Е. Дубинов、Lyubov' A Mytareva2010-08-09Physics-Uspekhi

The current knowledge of the physics of electromagnetic cloaking of material objects by the wave flow method is reviewed. Experiments demonstrating the feasibility of this cloaking method are described. Some aspects of calculating cloak profiles are examined, and achievements and unsolved problems in the theory of the…

Metamaterials and Metasurfaces ApplicationsElectromagnetic Scattering and AnalysisAdvanced Antenna and Metasurface Technologies

Kinetics of Oxidation of 2-Butanol and Isobutanol in a Jet-Stirred Reactor: Experimental Study and Modeling Investigation

Casimir Togbé、Amir Mzé-Ahmed、Philippe Dagaut2010-08-09Energy & Fuels

The kinetics of oxidation of two butanol isomers (2-butanol and isobutanol) were studied experimentally using a fused silica jet stirred reactor (JSR). The experiments were performed in the temperature range of 770−1250 K, at 10 atm, for equivalence ratios in the range of 0.275−4), and with an initial fuel concentrati…

Catalytic Processes in Materials ScienceCatalysis and Hydrodesulfurization StudiesCatalysis and Oxidation Reactions

Theoretical studies on the thermoelectric figure of merit of nanograined bulk silicon

Qing Hao、Gaohua Zhu、Giri Joshi 等 7 位作者2010-08-09Applied Physics Letters

In this paper, we investigate the phonon transport in silicon nanocomposites using Monte Carlo simulations considering frequency-dependent phonon mean free paths, and combine the phonon modeling with electron modeling to predict the thermoelectric figure of merit (ZT) of silicon nanocomposites. The model shows that wh…

Advanced Thermoelectric Materials and DevicesThermal properties of materialsThermal Radiation and Cooling Technologies

Interactions between Spider Silk and Cells – NIH/3T3 Fibroblasts Seeded on Miniature Weaving Frames

Joern W. Kuhbier、Christina Allmeling、Kerstin Reimers 等 9 位作者2010-08-09PLoS ONE

BACKGROUND: Several materials have been used for tissue engineering purposes, since the ideal matrix depends on the desired tissue. Silk biomaterials have come to focus due to their great mechanical properties. As untreated silkworm silk has been found to be quite immunogenic, an alternative could be spider silk. Not…

Electrospun Nanofibers in Biomedical ApplicationsSilk-based biomaterials and applicationsCollagen: Extraction and Characterization

A fast response and large electrically tunable-focusing imaging system based on switching of two modes of a liquid crystal lens

Hung-Chun Lin、Yi‐Hsin Lin2010-08-09Applied Physics Letters

We demonstrated a fast response and large tunable focusing imaging system consisting of a lens module and a liquid crystal (LC) lens based on the switching of two modes of a LC lens: the negative LC lens and positive LC lens. By discarding the conventional operation of a positive LC lens only in the imaging system, la…

Liquid Crystal Research AdvancementsAdvanced Optical Imaging TechnologiesElectrowetting and Microfluidic Technologies

Extraction and phytochemical investigation ofCalotropis procera: Effect of plant extracts on the activity of diverse muscles

Amal M. Youssef Moustafa、Safwat Ahmed、Z.I. Nabil 等 5 位作者2010-08-09Pharmaceutical Biology

CONTEXT: Calotropis procera (Ait.) R.Br. (Asclepiadaceae) is a shrub or small tree that grows wild in Egypt. Calotropis acts as a purgative, anthelmintic, anticoagulant, palliative (in problems with respiration, blood pressure), antipyretic, and analgesic, and induces neuromuscular blocking activity. Little research h…

Phytochemistry and Bioactive CompoundsMorinda citrifolia extract usesCynara cardunculus studies

Synthesis and Solution Phase Characterization of Strongly Photooxidizing Heteroleptic Cr(III) Tris-Dipyridyl Complexes

A.M. McDaniel、Huan-Wei Tseng、Niels H. Damrauer 等 4 位作者2010-08-09Inorganic Chemistry

We report the preparation and characterization of Cr(III) coordination complexes featuring the dimethyl 2,2'-bipyridine-4,4'-dicarboxylate (4-dmcbpy) ligand: [(phen)(2)Cr(4-dmcbpy)](OTf)(3) (1), [(Ph(2)phen)(2)Cr(4-dmcbpy)](OTf)(3) (4), [(Me(2)bpy)(2)Cr(4-dmcbpy)](OTf)(3) (7), and [Cr(4-dmcbpy)(3)](BF(4))(3) (8), wher…

Porphyrin and Phthalocyanine ChemistryPolyoxometalates: Synthesis and ApplicationsOxidative Organic Chemistry Reactions

Tuning Electronic and Magnetic Properties of Wurtzite ZnO Nanosheets by Surface Hydrogenation

Qing Tang、Yafei Li、Zhen Zhou 等 5 位作者2010-08-09ACS Applied Materials & Interfaces

Through density functional theory computations, we systematically investigated the structural, electronic, and magnetic properties as well as the relative stabilities of fully and partially hydrogenated ZnO nanosheets. Unlike bare ZnO nanosheets terminating with polar {0001} surfaces, their hydrogenated counterparts p…

ZnO doping and propertiesAdvanced Condensed Matter PhysicsCopper-based nanomaterials and applications

Biomaterials for Brain Tissue Engineering

Jerani T. S. Pettikiriarachchi、Clare L. Parish、Molly S. Shoichet 等 5 位作者2010-08-09Australian Journal of Chemistry

Neurological disorders such as traumatic brain injuries or stroke result in neuronal loss and disruption of the brain parenchyma. Current treatment strategies are limited in that they can only mitigate the degeneration process or alleviate the symptoms but do not reverse the condition. In contrast, regenerative cell-b…

Electrospun Nanofibers in Biomedical ApplicationsSupramolecular Self-Assembly in MaterialsTissue Engineering and Regenerative Medicine

Enhanced electron correlation in rare-earth doped Ca3Co4O9

Yang Wang、Luxiang Xu、Yu Sui 等 6 位作者2010-08-09Applied Physics Letters

Thermoelectric and thermodynamic properties of a series of Ca-site rare-earth R3+ doped Ca3Co4O9 were investigated. For a fixed doping level, with the reduction in R3+ radius, thermopower is found to gradually increase despite the carrier concentration remains unchanged. The scaling behavior between thermopower and el…

Advanced Thermoelectric Materials and DevicesMagnetic and transport properties of perovskites and related materialsThermal Expansion and Ionic Conductivity

Adsorption of hematite nanoparticles onto Caco-2 cells and the cellular impairments: effect of particle size

Wen Zhang、Madhavi Kalive、David G. Capco 等 4 位作者2010-08-09Nanotechnology

The increasing applications of engineered nanomaterials nowadays have elevated the potential of human exposure through various routes including inhalation, skin penetration and digestion. To date there is scarce information on a quantitative description of the interactions between nanoparticles (NPs) and cell surfaces…

Nanoparticles: synthesis and applicationsHeavy Metal Exposure and ToxicityElectrochemical Analysis and Applications

Relationship between fiber chemical treatment and properties of recycled pp/bamboo fiber composites

Nguyen Tri Phuong、Cyrille Sollogoub、Alain Guinault2010-08-09Journal of Reinforced Plastics and Composites

This article reports the preparation of recycled polypropylene (RPP)/bamboo fiber (BF) composite via direct melt blends using a twin screw extruder. The effects of the chemical treatment of BF surface (alkaline and acetylation) on fiber structure and composite mechanical, thermal, rheological properties have been inve…

Polymer Nanocomposites and PropertiesNatural Fiber Reinforced CompositesBamboo properties and applications

Classic and Advanced Ceramics: From Fundamentals to Applications

Robert B. Heimann2010-08-09OpenAlex

Preface INTRODUCTION TO CLASSIC CERAMICS Ceramics through the Ages, and Technological Progress Classification of Ceramics MINERALOGY, STRUCTURE, AND GREEN PROCESSING OF CLAY MINERALS Natural Clay Minerals Synthetic Raw Materials Processing and Forming of Clay Powders Rheology of Clay Particle Suspensions Drying of Gre…

Ferroelectric and Piezoelectric Materials

Synthesis and Functionalization of Asymmetrical Benzo-Fused BODIPY Dyes

Lijuan Jiao、Changjiang Yu、Mingming Liu 等 8 位作者2010-08-09The Journal of Organic Chemistry

A series of asymmetrical benzo-fused BODIPY dyes were synthesized from the Sonogashira coupling and nucleophilic substitution reactions on the 3-halogenated benzo-fused BODIPY, generated from readily available 3-halogeno-1-formylisoindoles in a two-step synthetic procedure. This novel BODIPY platform provides an easy…

Molecular Sensors and Ion DetectionNanoplatforms for cancer theranosticsLuminescence and Fluorescent Materials

Band Gap and Composition Engineering on a Nanocrystal (BCEN) in Solution

Xiaogang Peng2010-08-09Accounts of Chemical Research

Colloidal nanocrystals with "artificial" composition and electron band structure promise to expand the fields of nanomaterials and inorganic chemistry. Despite their promise as functional materials, the fundamental science associated with the synthesis, characterization, and properties of colloidal nanocrystals is sti…

Advanced Photocatalysis TechniquesQuantum Dots Synthesis And PropertiesNanocluster Synthesis and Applications